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LY310762

CAT: 0127-BUP10559-04Size: 50 mgDry Ice: NoHazardous: No
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CAT#:0127-BUP10559-04Size:50 mg
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CAS Number
192927-92-7
Synonyms
LY310762 HCl
Purity
=98%
Smiles
Cl.CC1(C)C(=O)N(CCN2CCC(CC2)C(=O)c2ccc(F)cc2)c2ccccc12

Chemical Information

1-(2-(4-(4-Fluorobenzoyl)piperidin-1-yl)ethyl)-3,3-dimethylindolin-2-one hydrochloride

LY-310762 hydrochloride is a hydrochloride resulting from the formal reation of equimolar amount of LY-310762 with hydrogen chloride. A potent and selective antagonist for the 5-hydroxytryptamine 1D (5-HT1D) receptor. It has a role as a serotonergic antagonist and a receptor modulator. It contains a LY-310762(1+).

CAS Number192927-92-7
PubChem CID11957576
IUPAC Name1-[2-[4-(4-fluorobenzoyl)piperidin-1-yl]ethyl]-3,3-dimethylindol-2-one;hydrochloride
Molecular FormulaC24H28ClFN2O2
Molecular Weight430.9
Topological Polar Surface Area40.6
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Heavy Atom Count30
Formal Charge0
Complexity606
SMILES
CC1(C2=CC=CC=C2N(C1=O)CCN3CCC(CC3)C(=O)C4=CC=C(C=C4)F)C.Cl
InChI
InChI=1S/C24H27FN2O2.ClH/c1-24(2)20-5-3-4-6-21(20)27(23(24)29)16-15-26-13-11-18(12-14-26)22(28)17-7-9-19(25)10-8-17;/h3-10,18H,11-16H2,1-2H3;1H
InChIKey
BOCLFQZPFYNVFD-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of 1-(2-(4-(4-Fluorobenzoyl)piperidin-1-yl)ethyl)-3,3-dimethylindolin-2-one hydrochloride
CAS: 192927-92-7
CID: 11957576
Formula: C24H28ClFN2O2
MW: 430.9
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight430.9
Hydrogen Bond Donor Count1
Hydrogen Bond Acceptor Count4
Rotatable Bond Count5
Exact Mass430.1823340
Monoisotopic Mass430.1823340
Topological Polar Surface Area40.6 Ų
Heavy Atom Count30
Formal Charge0
Complexity606
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count2
Compound Is CanonicalizedYes

Alternative Products

CatalogName
B2250-10LY310762
A11106-200LY310762 200mg
C08765LY310762 HCl
A11106-10LY310762 10mg
A11106-100LY310762 100mg
A11106-50LY310762 50mg
A11106-25LY310762 25mg
A11106-5LY310762 5mg
A11106-10mM-DLY310762 10mM * 1mL in DMSO

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